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5,7,2'-TRIHYDROXY-6-(3-HYDROXY-3-METHYLBUTYL)-[(6'',6''-DIMETHYLPYRANO-(2'',3'':4',5')]-ISOFLAVONE
SpectraBase Compound ID 5Ghp3tTdDbY
InChI InChI=1S/C25H26O7/c1-24(2,30)7-6-14-17(26)11-20-21(22(14)28)23(29)16(12-31-20)15-9-13-5-8-25(3,4)32-19(13)10-18(15)27/h5,8-12,26-28,30H,6-7H2,1-4H3
InChIKey KGYHISLEEHDLNF-UHFFFAOYSA-N
Mol Weight 438.48 g/mol
Molecular Formula C25H26O7
Exact Mass 438.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Esb3n3Jrzi
Name 5,7,2'-TRIHYDROXY-6-(3-HYDROXY-3-METHYLBUTYL)-[(6'',6''-DIMETHYLPYRANO-(2'',3'':4',5')]-ISOFLAVONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H26O7
InChI InChI=1S/C25H26O7/c1-24(2,30)7-6-14-17(26)11-20-21(22(14)28)23(29)16(12-31-20)15-9-13-5-8-25(3,4)32-19(13)10-18(15)27/h5,8-12,26-28,30H,6-7H2,1-4H3
InChIKey KGYHISLEEHDLNF-UHFFFAOYSA-N
Literature Reference Author S.E.DREWES,M.H.HORN,O.Q.MUNRO,J.T.B.DHLAMINI,J.J.M.MEYER,N.C .RAKUAMBO
Literature Reference Citation PHYTOCHEM.,59,739(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00035-3
Molecular Weight 438.477 g/mol
Solvent DMSO-D6
Source File Reference UWVN2793